N-[4-(3-acetamidoisoquinolin-4-yl)phenyl]-2-[bis(2-hydroxyethyl)amino]ethanamide

Systemtic Name: N-[4-(3-acetamidoisoquinolin-4-yl)phenyl]-2-[bis(2-hydroxyethyl)amino]ethanamide Openeye Name: N-[4-(3-acetamido-4-isoquinolyl)phenyl]-2-[bis(2-hydroxyethyl)amino]acetamide CAS Name: N-[4-(3-acetamido-4-isoquinolinyl)phenyl]-2-[bis(2-hydroxyethyl)amino]acetamide IUPAC Name: N-[4-(3-acetamidoisoquinolin-4-yl)phenyl]-2-[bis(2-hydroxyethyl)amino]acetamide Traditional Name: N-[4-(3-acetamido-4-isoquinolyl)phenyl]-2-[bis(2-hydroxyethyl)amino]acetamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)NC(=O)CN(CCO)CCO

Isomeric SMILES

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)NC(=O)CN(CCO)CCO

InChI

InChI=1S/C23H26N4O4/c1-16(30)25-23-22(20-5-3-2-4-18(20)14-24-23)17-6-8-19(9-7-17)26-21(31)15-27(10-12-28)11-13-29/h2-9,14,28-29H,10-13,15H2,1H3,(H,26,31)(H,24,25,30)